Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 1.00 |
| ▸ | NPC1 | O15118 | 2/20 | 1.00 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.79 |
| ▸ | MEN1 | O00255 | 5/20 | 0.77 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.77 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.77 |
| ▸ | MAPT | P10636 | 2/20 | 0.77 |
| ▸ | POLB | P06746 | 2/20 | 0.66 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.66 |
| ▸ | THRB | P10828 | 1/20 | 0.66 |
| ▸ | HPGD | P15428 | 1/20 | 0.66 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.66 |
| ▸ | NME2 | P22392 | 2/20 | 0.59 |
| ▸ | CCR3 | P51677 | 1/20 | 0.58 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.55 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.55 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.55 |
| ▸ | TUBB | P07437 | 2/20 | 0.55 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.55 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL21992755 | 1.00 | RAB9A (1.00) | RAB9ANPC1ALOX5MEN1KMT2A | |
| Isaindigotone SCHEMBL29519815 | 0.88 | ALOX5 (1.00) | RAB9ANPC1ALOX5MEN1KMT2A | |
| SCHEMBL11080702 | 0.88 | RAB9A (0.78) | RAB9ANPC1ALOX5MEN1KMT2A | |
| SCHEMBL11090834 | 0.88 | RAB9A (0.78) | RAB9ANPC1ALOX5MEN1KMT2A | |
| SCHEMBL11080699 | 0.88 | RAB9A (0.78) | RAB9ANPC1ALOX5MEN1KMT2A | |
| SCHEMBL11090836 | 0.88 | RAB9A (0.78) | RAB9ANPC1ALOX5MEN1KMT2A | |
| SCHEMBL11083485 | 0.88 | RAB9A (0.78) | RAB9ANPC1ALOX5MEN1KMT2A | |
| SCHEMBL11083488 | 0.88 | RAB9A (0.78) | RAB9ANPC1ALOX5MEN1KMT2A | |
| SCHEMBL10856275 | 0.83 | MEN1 (0.73) | RAB9ANPC1ALOX5MEN1KMT2A | |
| SCHEMBL10856266 | 0.83 | MEN1 (0.73) | RAB9ANPC1ALOX5MEN1KMT2A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013059582-A2 | SMALL MOLECULE INHIBITORS OF HISTONE DEACTEYLASES | NUPOTENTIAL, INC. (US) | 2013-04-25 | — | — | WO | disclosed |